6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione

C25H17N3O3 — CID 135420702

IUPAC6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione
SMILESO=c1[nH]c(=O)n(-c2ccccc2)c(O)c1/C=C1/C(c2ccccc2)=Nc2ccccc21
InChIInChI=1S/C25H17N3O3/c29-23-20(24(30)28(25(31)27-23)17-11-5-2-6-12-17)15-19-18-13-7-8-14-21(18)26-22(19)16-9-3-1-4-10-16/h1-15,30H,(H,27,29,31)/b19-15+
InChIKeyKMQQYZHXBFWSMY-XDJHFCHBSA-N
MW407.43 g/mol
LogP3.91
Rot. Bonds3

About 6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione

6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione (PubChem CID 135420702) has the molecular formula C25H17N3O3 and a molecular weight of 407.43 g/mol. Its IUPAC name is 6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione.

Molecular Properties

Compound Name6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione
PubChem CID135420702
Molecular FormulaC25H17N3O3
Molecular Weight407.43 g/mol
Exact Mass407.13
IUPAC Name6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione
SMILESO=c1[nH]c(=O)n(-c2ccccc2)c(O)c1/C=C1/C(c2ccccc2)=Nc2ccccc21
InChIInChI=1S/C25H17N3O3/c29-23-20(24(30)28(25(31)27-23)17-11-5-2-6-12-17)15-19-18-13-7-8-14-21(18)26-22(19)16-9-3-1-4-10-16/h1-15,30H,(H,27,29,31)/b19-15+
InChIKeyKMQQYZHXBFWSMY-XDJHFCHBSA-N
XLogP3.91
TPSA87.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.43
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(5E)-1-(4-fluorophenyl)-5-(1H-indol-3-ylmethylidene)-1,3-diazinane-2,4,6-trione
CID 135469945
(5Z)-5-(1H-indol-3-ylmethylidene)-1-(naphthalen-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione
CID 135438774
(5Z)-5-(1H-indol-3-ylmethylidene)-1-phenyl-1,3-diazinane-2,4,6-trione
CID 135458887
5-[[4-(Diethylamino)anilino]methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione
CID 659624
5-(1H-Indol-3-ylmethylene)-2-thioxo-1,3-di-o-tolyl-dihydro-pyrimidine-4,6-dione
CID 135421580
6-hydroxy-5-[(Z)-indol-3-ylidenemethyl]-1-(2-phenylphenyl)pyrimidine-2,4-dione
CID 136152923
(5E)-5-[1-(2,3-dihydro-1H-inden-5-ylamino)ethylidene]-6-hydroxy-3-phenylpyrimidine-2,4(3H,5H)-dione
CID 1409762
(5E)-1-(3-fluorophenyl)-5-(1H-indol-3-ylmethylidene)-1,3-diazinane-2,4,6-trione
CID 135458290
5-[(3-Methylanilino)methylidene]-1-(2-methylphenyl)-1,3-diazinane-2,4,6-trione
CID 582523
5-(1H-indol-3-ylmethylene)-1-(2-methylphenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
CID 135403101
(5E)-1-benzyl-5-(1H-indol-3-ylmethylidene)-1,3-diazinane-2,4,6-trione
CID 135452102
(5E)-5-({[2-(cyclohex-1-en-1-yl)ethyl]amino}methylidene)-1-(4-methylphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione
CID 2244548

Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione?
The IUPAC name of 6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione (CID 135420702) is 6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione.
What is the SMILES notation for 6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione?
The canonical SMILES for 6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione is O=c1[nH]c(=O)n(-c2ccccc2)c(O)c1/C=C1/C(c2ccccc2)=Nc2ccccc21.
What is the InChIKey of 6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione?
The InChIKey is KMQQYZHXBFWSMY-XDJHFCHBSA-N. The full InChI is InChI=1S/C25H17N3O3/c29-23-20(24(30)28(25(31)27-23)17-11-5-2-6-12-17)15-19-18-13-7-8-14-21(18)26-22(19)16-9-3-1-4-10-16/h1-15,30H,(H,27,29,31)/b19-15+.
What are the key properties of 6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione?
6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione has a molecular weight of 407.43 g/mol, XLogP of 3.91, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-1-phenyl-5-[(E)-(2-phenylindol-3-ylidene)methyl]pyrimidine-2,4-dione is sourced from PubChem (CID 135420702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).